N-[1-(4-methoxyphenyl)cyclopropyl]-2-phenoxyacetamide

C18H19NO3 — CID 113091147

IUPACN-[1-(4-methoxyphenyl)cyclopropyl]-2-phenoxyacetamide
SMILESCOc1ccc(C2(NC(=O)COc3ccccc3)CC2)cc1
InChIInChI=1S/C18H19NO3/c1-21-15-9-7-14(8-10-15)18(11-12-18)19-17(20)13-22-16-5-3-2-4-6-16/h2-10H,11-13H2,1H3,(H,19,20)
InChIKeyCSROBCXSCFYQRX-UHFFFAOYSA-N
MW297.35 g/mol
LogP2.88
Rot. Bonds6

About N-[1-(4-methoxyphenyl)cyclopropyl]-2-phenoxyacetamide

N-[1-(4-methoxyphenyl)cyclopropyl]-2-phenoxyacetamide (PubChem CID 113091147) has the molecular formula C18H19NO3 and a molecular weight of 297.35 g/mol. Its IUPAC name is N-[1-(4-methoxyphenyl)cyclopropyl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[1-(4-methoxyphenyl)cyclopropyl]-2-phenoxyacetamide
PubChem CID113091147
Molecular FormulaC18H19NO3
Molecular Weight297.35 g/mol
Exact Mass297.14
IUPAC NameN-[1-(4-methoxyphenyl)cyclopropyl]-2-phenoxyacetamide
SMILESCOc1ccc(C2(NC(=O)COc3ccccc3)CC2)cc1
InChIInChI=1S/C18H19NO3/c1-21-15-9-7-14(8-10-15)18(11-12-18)19-17(20)13-22-16-5-3-2-4-6-16/h2-10H,11-13H2,1H3,(H,19,20)
InChIKeyCSROBCXSCFYQRX-UHFFFAOYSA-N
XLogP2.88
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.35
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(4-methoxyphenyl)cyclopropyl]-3-phenoxypropanamide
CID 113091150
N-[1-(4-methoxyphenyl)cyclopropyl]propanamide
CID 113091106
2-(4-fluorophenoxy)-N-(1-phenylcyclobutyl)acetamide
CID 51264441
1-[[2-(4-methoxyphenoxy)acetyl]amino]cyclobutane-1-carboxylic acid
CID 81158031
N-(1-naphthalen-1-ylcyclopropyl)-2-phenoxyacetamide
CID 110442268
1-[[2-(4-methoxyphenoxy)acetyl]amino]cycloheptane-1-carboxylic acid
CID 120538622
[1-[4-(4-methoxyphenyl)phenyl]cyclopropyl]carbamic acid
CID 121483236
N-[1-(4-methoxyphenyl)cyclobutyl]-3-oxobutanamide
CID 110477390
3-amino-N-[1-(4-methoxyphenyl)cyclohexyl]propanamide
CID 110478988
N-[4-(hydroxymethyl)oxan-4-yl]-2-(4-methoxyphenoxy)acetamide
CID 104630643
2-(4-methoxyphenoxy)-N-(2-phenoxyethyl)acetamide
CID 2265793
N-[2-(4-methoxyphenoxy)ethyl]-2-phenoxyacetamide
CID 17468348

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methoxyphenyl)cyclopropyl]-2-phenoxyacetamide?
The IUPAC name of N-[1-(4-methoxyphenyl)cyclopropyl]-2-phenoxyacetamide (CID 113091147) is N-[1-(4-methoxyphenyl)cyclopropyl]-2-phenoxyacetamide.
What is the SMILES notation for N-[1-(4-methoxyphenyl)cyclopropyl]-2-phenoxyacetamide?
The canonical SMILES for N-[1-(4-methoxyphenyl)cyclopropyl]-2-phenoxyacetamide is COc1ccc(C2(NC(=O)COc3ccccc3)CC2)cc1.
What is the InChIKey of N-[1-(4-methoxyphenyl)cyclopropyl]-2-phenoxyacetamide?
The InChIKey is CSROBCXSCFYQRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO3/c1-21-15-9-7-14(8-10-15)18(11-12-18)19-17(20)13-22-16-5-3-2-4-6-16/h2-10H,11-13H2,1H3,(H,19,20).
What are the key properties of N-[1-(4-methoxyphenyl)cyclopropyl]-2-phenoxyacetamide?
N-[1-(4-methoxyphenyl)cyclopropyl]-2-phenoxyacetamide has a molecular weight of 297.35 g/mol, XLogP of 2.88, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methoxyphenyl)cyclopropyl]-2-phenoxyacetamide is sourced from PubChem (CID 113091147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).